5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-N-propyl-1,3,4-thiadiazol-2-amine

Systemtic Name: 5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methylsulfanyl]-N-propyl-1,3,4-thiadiazol-2-amine Openeye Name: 5-[(1-phenyltetrazol-5-yl)methylsulfanyl]-N-propyl-1,3,4-thiadiazol-2-amine CAS Name: 5-[(1-phenyl-5-tetrazolyl)methylthio]-N-propyl-1,3,4-thiadiazol-2-amine IUPAC Name: 5-[(1-phenyltetrazol-5-yl)methylsulfanyl]-N-propyl-1,3,4-thiadiazol-2-amine Traditional Name: [5-[(1-phenyltetrazol-5-yl)methylthio]-1,3,4-thiadiazol-2-yl]-propyl-amine Formula: C13H15N7S2 MolecularWeight: 333.4351

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Descriptors Computed from Structure

Canonical SMILES:

CCCNC1=NN=C(S1)SCC2=NN=NN2C3=CC=CC=C3

Isomeric SMILES

CCCNC1=NN=C(S1)SCC2=NN=NN2C3=CC=CC=C3

InChI

InChI=1S/C13H15N7S2/c1-2-8-14-12-16-17-13(22-12)21-9-11-15-18-19-20(11)10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,14,16)